N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide

C24H24N2O3 — CID 3148797

IUPACN-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(O)Cn2c3ccccc3c3ccccc32)c(C)c1
InChIInChI=1S/C24H24N2O3/c1-16-13-18(25-17(2)27)11-12-24(16)29-15-19(28)14-26-22-9-5-3-7-20(22)21-8-4-6-10-23(21)26/h3-13,19,28H,14-15H2,1-2H3,(H,25,27)
InChIKeyLSTQCMQSBHWXKZ-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.50
Rot. Bonds6

About N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide

N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide (PubChem CID 3148797) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide
PubChem CID3148797
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(OCC(O)Cn2c3ccccc3c3ccccc32)c(C)c1
InChIInChI=1S/C24H24N2O3/c1-16-13-18(25-17(2)27)11-12-24(16)29-15-19(28)14-26-22-9-5-3-7-20(22)21-8-4-6-10-23(21)26/h3-13,19,28H,14-15H2,1-2H3,(H,25,27)
InChIKeyLSTQCMQSBHWXKZ-UHFFFAOYSA-N
XLogP4.50
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide?
The IUPAC name of N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide (CID 3148797) is N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide.
What is the SMILES notation for N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide?
The canonical SMILES for N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide is CC(=O)Nc1ccc(OCC(O)Cn2c3ccccc3c3ccccc32)c(C)c1.
What is the InChIKey of N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide?
The InChIKey is LSTQCMQSBHWXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-16-13-18(25-17(2)27)11-12-24(16)29-15-19(28)14-26-22-9-5-3-7-20(22)21-8-4-6-10-23(21)26/h3-13,19,28H,14-15H2,1-2H3,(H,25,27).
What are the key properties of N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide?
N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide has a molecular weight of 388.47 g/mol, XLogP of 4.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-carbazol-9-yl-2-hydroxypropoxy)-3-methylphenyl]acetamide is sourced from PubChem (CID 3148797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).